2-Methoxybutyl Acetate

CAT: 0024-sc-472407Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-472407Size:5 g

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CAS Number

1173168-18-7

Chemical Information

2-Methoxybutyl Acetate

CAS Number	1173168-18-7
PubChem CID	14993724
IUPAC Name	2-methoxybutyl acetate
Molecular Formula	C7H14O3
Molecular Weight	146.18
XLogP	0.9
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	10
Formal Charge	0
Complexity	101

SMILES

CCC(COC(=O)C)OC

InChI

InChI=1S/C7H14O3/c1-4-7(9-3)5-10-6(2)8/h7H,4-5H2,1-3H3

InChIKey

ZWUWDFWEMWMTHX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1173168-18-7

CID: 14993724

Formula: C7H14O3

MW: 146.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	146.18
XLogP3	0.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	146.094294304
Monoisotopic Mass	146.094294304
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	101
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-472414	4-Methoxybutyl Acetate
sc-472184	3-Methoxybutyl Acetate
sc-484824	2- (1-Methoxybutyl) benzofuran
sc-487888	3-Methoxybutyl Thioglycolate
sc-356214A	1- (4-Methoxybutyl) piperazine
sc-356214	1- (4-Methoxybutyl) piperazine
sc-486284	3-Methoxybutyl 3-Mercaptopropionate
sc-497145	5-[1- (Diphenylmethyl) -1-methoxybutyl]-1H-imidazole
sc-298546	2,2-Difluoroethyl acetate
sc-298546A	2,2-Difluoroethyl acetate

Catalog	Name
OR938072-01	2-Methoxybutyl acetate
OR940548-01	3-Methoxybutyl acetate
OR470597	3- (2-Piperidyl) propyl Acetate Acetate
045315-01	Cellosolve Acetate (2-Ethoxy ethyl acetate)
AAA91505-01	2-Sitosterol Acetate (contains Campesterol Acetate)
S-255	Amyl acetate (isomers of pentyl acetate and 2-pentyl acetate) - 1ML
PC2808-01	2,2-Difluoroethyl acetate
OR1042917-01	2-Pyridinemethanol, 2-acetate
TRC-A227740-1G	2-Acetate 2-Heptanol
HY-P2692B-01	DT-2 (acetate)